4,6-디-털트-부틸-3-메틸페놀

4,6-Di-tert-butyl-3-methylphenol

HCID 10346
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기본 정보

CAS
497-39-2
표준 SMILES
Cc1cc(O)c(C(C)(C)C)cc1C(C)(C)C
InChIKey
WYSSJDOPILWQDC-UHFFFAOYSA-N
분자식
C15H24O
평균 분자량
220.35 g/mol
단동위원소 질량
220.18271539

이름 및 식별자

우선 이름
4,6-Di-tert-butyl-3-methylphenol
IUPAC
2,4-ditert-butyl-5-methylphenol
현지명
4,6-디-털트-부틸-3-메틸페놀
영어명
4,6-Di-tert-butyl-m-cresol
분자식
C15H24O
분자량
220.35

이름 및 동의어

4,6-Di-tert-butyl-m-cresol497-39-23-Methyl-4,6-di-tert-butylphenol4,6-DI-TERT-BUTYL-3-METHYLPHENOL4,6-Di-t-butyl-m-cresolDi-tert-butyl-m-cresolm-Cresol, 4,6-di-tert-butyl-Phenol, 2,4-bis(1,1-dimethylethyl)-5-methyl-DTXSID10415022,4-Di-t-butyl-5-methylphenolHSDB 5669EINECS 207-847-7
이름 더 보기
4,6-디-털트-부틸-3-메틸페놀4,6-DI-TERT-부틸-M-크레졸2,4-DI-TERT-BUTYL-5-METHYLPHENOLdbmc4,6-DBMPDibutylcresolThymol Impurity 164,6-tert butyl m-cresol4,6-di-tert-buty-m-cresol4,6-di-tert-butyl-m-creso
2,4-Bis(1,1-dimethylethyl)-5-methylphenolBRN 2094885TMY866FL30DTXCID9021502AI3-154814-06-00-03510 (Beilstein Handbook Reference)4,6-DI-TERT-BUTYL-3-METHYLPHENOL [HSDB]Ditertbutylmcresol

데이터베이스 식별자

CAS
497-39-2
PubChem CID
10346
DTXSID
DTXSID1041502
ChEMBL
CHEMBL3183034
UNII
TMY866FL30
EC Number
207-847-7
Nikkaji
J6.101H

물성

구조 계산 물성

XLogP
5.3
극성 표면적
20.2 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
2
무거운 원자 수
16

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Phenols
SpringerMaterials PropertiesBoiling point
Density0.912 @ 80 °C/4 °C
Color/FormCRYSTALS
SolubilityPRACTICALLY INSOL IN WATER, ETHYLENE GLYCOL; SOL IN ALC, BENZENE, CARBON TETRACHLORIDE, ETHER, ACETONE
Endocrine DisruptorsPotential endocrine disrupting compound

물리화학적 성질

녹는점
62 °C · 62°C
끓는 점
284 ℃ · 284℃
밀도
0.927 · 0.927
굴절률
1.5021 · 1.5021 (estimate)
인화점
128 ℃ · 128℃
저장 조건
2 · Sealed in dry,2-8°C

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 12.2% (6 of 49) of reports.

Warning

H302 (87.8%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 49 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: Phenol, 2,4-bis(1,1-dimethylethyl)-5-methyl-

Phenol, 2,4-bis(1,1-dimethylethyl)-5-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 2,4-bis(1,1-dimethylethyl)-5-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Phenol, 2,4-bis(1,1-dimethylethyl)-5-methyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards SummaryCauses gastrointestinal bleeding in lethal-dose feeding studies of mice; [RTECS] See Phenol.
Hazard Classes and CategoriesAcute Tox. 4 (87.8%)

안전 데이터

tsca
TSCA listed
rtecs
GO7800000
HS 번호
2907.19.1000
risk_code
20/21/22-36/37/38
safety_code
26-36/37/39
유해 물질 데이터
497-39-2(Hazardous Substances Data)

화학 및 산업

용도 및 제조

Uses · 6건

Used to make rubber chemicals, modified phenolic resins, and synthetic ambrette musks; [HSDB]

INTERMEDIATE IN PRODUCTION OF RUBBER CHEM, MODIFIED PHENOLIC RESINS, SYNTHETIC MUSKS OF AMBRETTE TYPE

CHEM INT FOR PHENOLIC RESINS

CHEM INT FOR 3-METHYL-6-TERT-BUTYLPHENOL

CHEM INT FOR MUSK AMBRETTE SYNTHESIS

For more Uses (Complete) data for 4,6-DI-TERT-BUTYL-3-METHYLPHENOL (6 total), please visit the HSDB record page.

U.S. Exports · 2건

(1979) No Data

(1981) No Data

U.S. Imports · 2건

(1979) No Data

(1981) No Data

U.S. Production · 3건

2022: 1,000,000 - <5,000,000 lb

(1977) AT LEAST 4.54X10+8 GRAMS

(1981) No Data

Methods of Manufacturing · 2건

WEINRICH; IND ENG CHEM 35: 264 (1943)

PROBABLY BY REACTION OF ISOBUTYLENE WITH MIXED M- & P-CRESOLS IN THE PRESENCE OF SULFURIC ACID OR OLEUM AS A CATALYST TO GIVE AN ISOMERIC MIXT, FOLLOWED BY FRACTIONATION

General Manufacturing InformationPhenol, 2,4-bis(1,1-dimethylethyl)-5-methyl-: ACTIVE

응용 분야

용도Condensation of 4,6-Di-tert-butyl-m-cresol can produce regulated food additive di-tert-butyl-m-cresyl phosphonite.

상·하류 제품 정보

공급사91 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
常州市君驰化工有限公司0519-85518211 15195021697 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]

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